Mrv0541 05061306592D 3 2 0 0 0 0 999 V2000 -0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 Se 0 0 0 0 0 0 0 0 0 0 0 0 3 1 1 0 0 0 0 3 2 1 0 0 0 0 M END > <DATABASE_ID> FDB011225 > <DATABASE_NAME> foodb > <SMILES> C[Se]C > <INCHI_IDENTIFIER> InChI=1S/C2H6Se/c1-3-2/h1-2H3 > <INCHI_KEY> RVIXKDRPFPUUOO-UHFFFAOYSA-N > <FORMULA> C2H6Se > <MOLECULAR_WEIGHT> 109.03 > <EXACT_MASS> 109.96347202 > <JCHEM_ACCEPTOR_COUNT> 0 > <JCHEM_AVERAGE_POLARIZABILITY> 6.681577872472303 > <JCHEM_BIOAVAILABILITY> 1 > <JCHEM_DONOR_COUNT> 0 > <JCHEM_FORMAL_CHARGE> 0 > <JCHEM_GHOSE_FILTER> 0 > <JCHEM_IUPAC> (methylselanyl)methane > <ALOGPS_LOGP> 0.09 > <JCHEM_LOGP> 0.6333000000000002 > <ALOGPS_LOGS> -0.19 > <JCHEM_MDDR_LIKE_RULE> 0 > <JCHEM_NUMBER_OF_RINGS> 0 > <JCHEM_PHYSIOLOGICAL_CHARGE> 0 > <JCHEM_POLAR_SURFACE_AREA> 0 > <JCHEM_REFRACTIVITY> 24.2131 > <JCHEM_ROTATABLE_BOND_COUNT> 0 > <JCHEM_RULE_OF_FIVE> 1 > <ALOGPS_SOLUBILITY> 7.10e+01 g/l > <JCHEM_TRADITIONAL_IUPAC> dimethylselenide > <JCHEM_VEBER_RULE> 1 > <FOODB_ID> FDB011225 > <GENERIC_NAME> Dimethyl selenide $$$$